{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4427656 -3.6700326 -11.8340226 ] [ 5.7840999 -5.9483718 3.5598475 ] [ -1.1329666 -6.3817838 10.7717207 ] [ -2.0690338 8.5556045 -0.9887446 ] [ 3.8606662 7.4445837 -1.508801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.032244850265899e-08 -5.880040477738268e-09 -1.896019449594793e-08 ] [ 9.267149708501737e-09 -9.530342308304521e-09 5.703504485103314e-09 ] [ -1.815212613622424e-09 -1.022474488759973e-08 1.725819921351412e-08 ] [ -3.314957609316229e-09 1.370758961964525e-08 -1.584143495113676e-09 ] [ 6.18546917731357e-09 1.192753805399726e-08 -2.417365707555834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0322263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.062515394860273e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8946301 2.094887 0.9499266 ] [ 3.0022476 1.5289409 2.4376782 ] [ 0.7645848 1.8987917 3.5805968 ] [ 0.6022349 4.1998801 2.5181352 ] [ 2.8399145 3.8300414 1.3752423 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.946301e-11 2.094887e-10 9.499266e-11 ] [ 3.0022476e-10 1.5289409e-10 2.4376782e-10 ] [ 7.645848e-11 1.8987917e-10 3.5805968e-10 ] [ 6.022349e-11 4.1998801e-10 2.5181352e-10 ] [ 2.8399145e-10 3.8300414e-10 1.3752423e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.44e-05 3e-07 -8.7e-06 ] [ 1.27e-05 2.6e-06 1.7e-05 ] [ -2.9e-06 5e-07 -1.13e-05 ] [ 1.56e-05 -3.7e-06 5.3e-06 ] [ -1.1e-05 3e-07 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.30713435296e-14 4.806529901999999e-16 -1.39389367158e-14 ] [ 2.03476432518e-14 4.165659248399999e-15 2.723700277799999e-14 ] [ -4.6463122386e-15 8.010883169999999e-16 -1.81045959642e-14 ] [ 2.49939554904e-14 -5.9280535458e-15 8.4915361602e-15 ] [ -1.7623942974e-14 4.806529901999999e-16 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335170976765e-18 } }